Multimodal hybrid linear auto-weighting models: Application of ultraviolet spectroscopy for growth prediction of marine pathogenic bacteria

IF 4.9 2区 化学 Q1 CHEMISTRY, ANALYTICAL Microchemical Journal Pub Date : 2025-03-03 DOI:10.1016/j.microc.2025.113209
Ying Chen, Jin Wang, Junfei Liu, Junru Zhang, Chenglong Wang, Wanwen Li
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Abstract

Spectral contactless detection techniques are real-time and extremely sensitive. It shows great potential for rapid prediction of growth trends of marine microorganisms. This paper proposes a real-time detection system that integrates ultraviolet spectroscopy (UV) technology with the PPSA model (1DCNN-PLSR Parallel 1DCNN-SVR Adaptation). The system realized the detection of microbial concentration and the prediction of growth trend. A UV absorption spectral dataset was constructed by collecting ultraviolet (UV) spectral data of actinomycetes during growth and combining it with the microscopic hemocyte plate counting method. For multiple feature intervals characterizing actinomycetes in UV absorption spectral curves, spectral data feature extraction was performed by a one-dimensional convolutional neural network (1DCNN), and prediction experiments were conducted using multiple parallel network models. Further exploration of weight adaptive fine-tuning of model parameter shares to optimize overall prediction accuracy. The experimental evaluation showed that the model achieved an R2 of 0.9994, an MAE of 0.4181, and an average error of 2.0 * 106cells/mL in the assay results. Rapid characterization and detection of the growth of known and unknown pathogenic bacteria using ultraviolet absorption spectroscopy is valuable for the study of marine and human ecosystems.

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多模态混合线性自加权模型:紫外光谱在海洋致病菌生长预测中的应用
光谱非接触式检测技术是实时的,非常敏感。它在快速预测海洋微生物的生长趋势方面具有很大的潜力。本文提出了一种将紫外光谱技术与PPSA模型(1DCNN-PLSR并行1DCNN-SVR自适应)相结合的实时检测系统。该系统实现了微生物浓度的检测和生长趋势的预测。通过收集放线菌生长过程中的紫外光谱数据,结合显微镜血细胞平板计数法,构建了放线菌紫外吸收光谱数据集。针对紫外吸收光谱曲线中多个特征区间的放线菌特征,采用一维卷积神经网络(1DCNN)进行光谱数据特征提取,并采用多个并行网络模型进行预测实验。进一步探索模型参数份额的权重自适应微调,优化整体预测精度。实验评价表明,该模型检测结果的R2为0.9994,MAE为0.4181,平均误差为2.0 * 106cells/mL。利用紫外吸收光谱快速表征和检测已知和未知致病菌的生长对海洋和人类生态系统的研究具有重要价值。
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来源期刊
Microchemical Journal
Microchemical Journal 化学-分析化学
CiteScore
8.70
自引率
8.30%
发文量
1131
审稿时长
1.9 months
期刊介绍: The Microchemical Journal is a peer reviewed journal devoted to all aspects and phases of analytical chemistry and chemical analysis. The Microchemical Journal publishes articles which are at the forefront of modern analytical chemistry and cover innovations in the techniques to the finest possible limits. This includes fundamental aspects, instrumentation, new developments, innovative and novel methods and applications including environmental and clinical field. Traditional classical analytical methods such as spectrophotometry and titrimetry as well as established instrumentation methods such as flame and graphite furnace atomic absorption spectrometry, gas chromatography, and modified glassy or carbon electrode electrochemical methods will be considered, provided they show significant improvements and novelty compared to the established methods.
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